5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine

C10H19N — CID 59251857

IUPAC5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine
SMILESCC1CCC2CC(N)CC2C1
InChIInChI=1S/C10H19N/c1-7-2-3-8-5-10(11)6-9(8)4-7/h7-10H,2-6,11H2,1H3
InChIKeyBUWYKHNXPUOHFP-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.16
Rot. Bonds

About 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine

5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine (PubChem CID 59251857) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine.

Molecular Properties

Compound Name5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine
PubChem CID59251857
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine
SMILESCC1CCC2CC(N)CC2C1
InChIInChI=1S/C10H19N/c1-7-2-3-8-5-10(11)6-9(8)4-7/h7-10H,2-6,11H2,1H3
InChIKeyBUWYKHNXPUOHFP-UHFFFAOYSA-N
XLogP2.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine?
The IUPAC name of 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine (CID 59251857) is 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine.
What is the SMILES notation for 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine?
The canonical SMILES for 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine is CC1CCC2CC(N)CC2C1.
What is the InChIKey of 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine?
The InChIKey is BUWYKHNXPUOHFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-7-2-3-8-5-10(11)6-9(8)4-7/h7-10H,2-6,11H2,1H3.
What are the key properties of 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine?
5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine has a molecular weight of 153.27 g/mol, XLogP of 2.16, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-amine is sourced from PubChem (CID 59251857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).